6-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]pyridine-3-carbonitrile

Systemtic Name: 6-[(2-oxidanylidene-1,3-benzoxathiol-6-yl)oxy]pyridine-3-carbonitrile Openeye Name: 6-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]pyridine-3-carbonitrile CAS Name: 6-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]-3-pyridinecarbonitrile IUPAC Name: 6-[(2-oxo-1,3-benzoxathiol-6-yl)oxy]pyridine-3-carbonitrile Traditional Name: 6-[(2-keto-1,3-benzoxathiol-6-yl)oxy]nicotinonitrile Formula: C13H6N2O3S MolecularWeight: 270.26334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC3=NC=C(C=C3)C#N)OC(=O)S2

Isomeric SMILES

C1=CC2=C(C=C1OC3=NC=C(C=C3)C#N)OC(=O)S2

InChI

InChI=1S/C13H6N2O3S/c14-6-8-1-4-12(15-7-8)17-9-2-3-11-10(5-9)18-13(16)19-11/h1-5,7H